(2-ethylhydrazinyl) propanoate

C5H12N2O2 — CID 140581443

IUPAC(2-ethylhydrazinyl) propanoate
SMILESCCNNOC(=O)CC
InChIInChI=1S/C5H12N2O2/c1-3-5(8)9-7-6-4-2/h6-7H,3-4H2,1-2H3
InChIKeyRZYUPQYYWLKEAC-UHFFFAOYSA-N
MW132.16 g/mol
LogP-0.03
Rot. Bonds4

About (2-ethylhydrazinyl) propanoate

(2-ethylhydrazinyl) propanoate (PubChem CID 140581443) has the molecular formula C5H12N2O2 and a molecular weight of 132.16 g/mol. Its IUPAC name is (2-ethylhydrazinyl) propanoate.

Molecular Properties

Compound Name(2-ethylhydrazinyl) propanoate
PubChem CID140581443
Molecular FormulaC5H12N2O2
Molecular Weight132.16 g/mol
Exact Mass132.09
IUPAC Name(2-ethylhydrazinyl) propanoate
SMILESCCNNOC(=O)CC
InChIInChI=1S/C5H12N2O2/c1-3-5(8)9-7-6-4-2/h6-7H,3-4H2,1-2H3
InChIKeyRZYUPQYYWLKEAC-UHFFFAOYSA-N
XLogP-0.03
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.16
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

bis(2-ethylhydrazinyl) oxalate
CID 57041396
disodium;hydride;(propanoyloxyamino) propanoate
CID 175458235
(phosphorosoamino) propanoate
CID 134211328
propanoyl (113C)propanoate
CID 91179573
CID 87773794
CID 87773794
methyl propanoate;dihydrochloride
CID 140968159
(prop-1-en-2-ylamino) propanoate
CID 57193180
sodium;formamido propanoate;hydride
CID 174830035
CID 45052167
CID 45052167
lithium;hydride;methyl propanoate
CID 174158387
[[(2S)-2-hydroxypropanoyl]amino] propanoate
CID 176961692
(2-aminopropanoylamino) propanoate
CID 146291069

Frequently Asked Questions

What is the IUPAC name of (2-ethylhydrazinyl) propanoate?
The IUPAC name of (2-ethylhydrazinyl) propanoate (CID 140581443) is (2-ethylhydrazinyl) propanoate.
What is the SMILES notation for (2-ethylhydrazinyl) propanoate?
The canonical SMILES for (2-ethylhydrazinyl) propanoate is CCNNOC(=O)CC.
What is the InChIKey of (2-ethylhydrazinyl) propanoate?
The InChIKey is RZYUPQYYWLKEAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O2/c1-3-5(8)9-7-6-4-2/h6-7H,3-4H2,1-2H3.
What are the key properties of (2-ethylhydrazinyl) propanoate?
(2-ethylhydrazinyl) propanoate has a molecular weight of 132.16 g/mol, XLogP of -0.03, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylhydrazinyl) propanoate is sourced from PubChem (CID 140581443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).